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4,6-DIMETHYL-2-ALPHA-PHENYL-1,3-DITHIANE

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4,6-DIMETHYL-2-ALPHA-PHENYL-1,3-DITHIANE
SpectraBase Compound ID 5aksOxNeQ2r
InChI InChI=1S/C12H16S2/c1-9-8-10(2)14-12(13-9)11-6-4-3-5-7-11/h3-7,9-10,12H,8H2,1-2H3/t9-,10+,12-
InChIKey HPIUOJZLYNYVEM-PEGIJTEDSA-N
Mol Weight 224.38 g/mol
Molecular Formula C12H16S2
Exact Mass 224.069343 g/mol

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

13C Nuclear Magnetic Resonance (NMR) Chemical Shifts

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SpectraBase Spectrum ID 7MH3V3wmkxJ
Name 2-Phenyl-cis-4,cis-6-dimethyl-1,3-dithiane
CAS Registry Number 60311-45-7
Copyright Copyright © 2002-2025 Wiley-VCH GmbH. All Rights Reserved.
Formula C12H16S2
InChI InChI=1S/C12H16S2/c1-9-8-10(2)14-12(13-9)11-6-4-3-5-7-11/h3-7,9-10,12H,8H2,1-2H3/t9-,10+,12-
InChIKey HPIUOJZLYNYVEM-PEGIJTEDSA-N
Instrument Name Varian XL-100
Literature Reference E.L. Eliel, V.S. Rao, F.G. Riddell, J. Am. Chem. Soc. 98, 3583 (1976).
NMR Standard TMS
Origin Chemical Concepts. A Wiley Division. Weinheim, Germany
Solvent CDCl3